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(1S,2E,4S,7E,11S,12S)-11,12-EPOXY-4-HYDROXY-2,7-CEMBRADIEN-6-ONE
SpectraBase Compound ID 5VJ0I0AjM7T
InChI InChI=1S/C20H32O3/c1-14(2)16-8-10-19(4,22)13-17(21)12-15(3)6-7-18-20(5,23-18)11-9-16/h8,10,12,14,16,18,22H,6-7,9,11,13H2,1-5H3/b10-8+,15-12+/t16-,18-,19+,20-/m0/s1
InChIKey OHQNWKGVTLXYOM-QHYCLKELSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDjOa8iuxLn
Name (1S,4E,8S,9E,11S,14S)-4,8,14-trimethyl-8-oxidanyl-11-propan-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,9-dien-6-one
Alternate Name(s) (1S,4E,8S,9E,11S,14S)-8-hydroxy-11-isopropyl-4,8,14-trimethyl-15-oxabicyclo[12.1.0]pentadeca-4,9-dien-6-one (1S,4E,8S,9E,11S,14S)-8-hydroxy-4,8,14-trimethyl-11-propan-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,9-dien-6-one
CAS Registry Number 98064-73-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-14(2)16-8-10-19(4,22)13-17(21)12-15(3)6-7-18-20(5,23-18)11-9-16/h8,10,12,14,16,18,22H,6-7,9,11,13H2,1-5H3/b10-8+,15-12+/t16-,18-,19+,20-/m0/s1
InChIKey OHQNWKGVTLXYOM-QHYCLKELSA-N
Molecular Weight 320.473 g/mol
SMILES O[C@@]1(\C=C\[C@@](CC[C@@]2(O[C@]2(CC\C(=C\C(=O)C1)C)[H])C)(C(C)C)[H])C
SPLASH splash10-0006-9300000000-7a246912a1730324d3a2
Source of Spectrum J-50-4536-1
Wiley ID 1320431